| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Nc1cc([NH]n1)C1CCC(OC(=O)NC(C)C2CC2)C1)C1CCCCC1 |
| InChI | InChI | 1.06 | InChI=1S/C21H32N4O3/c1-13(14-7-8-14)22-21(27)28-17-10-9-16(11-17)18-12-19(25-24-18)23-20(26)15-5-3-2-4-6-15/h12-17H,2-11H2,1H3,(H,22,27)(H2,23,24,25,26)/t13-,16+,17+/m0/s1 |
| InChIKey | InChI | 1.06 | GNVCEPSJOONGHL-IAOVAPTHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](NC(=O)O[C@@H]1CC[C@@H](C1)c2[nH]nc(NC(=O)C3CCCCC3)c2)C4CC4 |
| SMILES | CACTVS | 3.385 | C[CH](NC(=O)O[CH]1CC[CH](C1)c2[nH]nc(NC(=O)C3CCCCC3)c2)C4CC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@H](C1CC1)NC(=O)O[C@@H]2CC[C@@H](C2)c3cc(n[nH]3)NC(=O)C4CCCCC4 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(C1CC1)NC(=O)OC2CCC(C2)c3cc(n[nH]3)NC(=O)C4CCCCC4 |
